6BWL
X-ray structure of Pal from Bacillus thuringiensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-04-07 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 0.9794 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 96.420, 98.341, 98.603 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 23.500 - 1.450 |
| R-factor | 0.13053 |
| Rwork | 0.129 |
| R-free | 0.15115 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2p5u |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.782 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.500 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.041 | 0.175 |
| Number of reflections | 82030 | 8031 |
| <I/σ(I)> | 53.7 | 8 |
| Completeness [%] | 98.9 | 97.9 |
| Redundancy | 7.3 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 8-12% PEG 5000, 100 mM MES, 2% MPD, 5 mM UDP |
